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PubMed code 17210250

Compile data set for download or QSAR
Found 45 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202123
PNG
(CHEMBL394655 | N-(2-((1,3-dioxoisoindolin-2-yl)met...)
Show SMILES COc1ccc(NC(=O)c2ccccn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C22H17N3O4/c1-29-15-9-10-18(24-20(26)19-8-4-5-11-23-19)14(12-15)13-25-21(27)16-6-2-3-7-17(16)22(25)28/h2-12H,13H2,1H3,(H,24,26)
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n/an/an/an/a 1.40E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202128
PNG
(CHEMBL247950 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2cccnn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C20H13ClN4O3/c21-13-7-8-16(23-18(26)17-6-3-9-22-24-17)12(10-13)11-25-19(27)14-4-1-2-5-15(14)20(25)28/h1-10H,11H2,(H,23,26)
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n/an/an/an/a>1.00E+5n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202130
PNG
(CHEMBL397393 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES COc1cccc(c1)C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C23H17ClN2O4/c1-30-17-6-4-5-14(12-17)21(27)25-20-10-9-16(24)11-15(20)13-26-22(28)18-7-2-3-8-19(18)23(26)29/h2-12H,13H2,1H3,(H,25,27)
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n/an/an/an/a 1.50E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202134
PNG
(CHEMBL398125 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2ccco2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C20H13ClN2O4/c21-13-7-8-16(22-18(24)17-6-3-9-27-17)12(10-13)11-23-19(25)14-4-1-2-5-15(14)20(23)26/h1-10H,11H2,(H,22,24)
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n/an/an/an/a 2.30E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202139
PNG
(CHEMBL246518 | N-(2-((1,3-dioxoisoindolin-2-yl)met...)
Show SMILES O=C(Nc1ccccc1CN1C(=O)c2ccccc2C1=O)c1ccccn1
Show InChI InChI=1S/C21H15N3O3/c25-19(18-11-5-6-12-22-18)23-17-10-4-1-7-14(17)13-24-20(26)15-8-2-3-9-16(15)21(24)27/h1-12H,13H2,(H,23,25)
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n/an/an/an/a 1.39E+4n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202143
PNG
(CHEMBL395675 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2cncs2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C19H12ClN3O3S/c20-12-5-6-15(22-17(24)16-8-21-10-27-16)11(7-12)9-23-18(25)13-3-1-2-4-14(13)19(23)26/h1-8,10H,9H2,(H,22,24)
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n/an/an/an/a 1.90E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202120
PNG
(CHEMBL247948 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2ncccn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C20H13ClN4O3/c21-13-6-7-16(24-18(26)17-22-8-3-9-23-17)12(10-13)11-25-19(27)14-4-1-2-5-15(14)20(25)28/h1-10H,11H2,(H,24,26)
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n/an/an/an/a<1.00E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202124
PNG
(CHEMBL245288 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES COc1ccccc1C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C23H17ClN2O4/c1-30-20-9-5-4-8-18(20)21(27)25-19-11-10-15(24)12-14(19)13-26-22(28)16-6-2-3-7-17(16)23(26)29/h2-12H,13H2,1H3,(H,25,27)
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n/an/an/an/a>1.00E+5n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202126
PNG
(CHEMBL246724 | N-(2-((1,3-dioxoisoindolin-2-yl)met...)
Show SMILES Fc1ccc(NC(=O)c2ccccn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C21H14FN3O3/c22-14-8-9-17(24-19(26)18-7-3-4-10-23-18)13(11-14)12-25-20(27)15-5-1-2-6-16(15)21(25)28/h1-11H,12H2,(H,24,26)
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n/an/an/an/a 1.50E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50156082
PNG
(CHEMBL362969 | N-(4-bromo-2-((1,3-dioxoisoindolin-...)
Show SMILES Brc1ccc(NC(=O)c2ccccn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C21H14BrN3O3/c22-14-8-9-17(24-19(26)18-7-3-4-10-23-18)13(11-14)12-25-20(27)15-5-1-2-6-16(15)21(25)28/h1-11H,12H2,(H,24,26)
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n/an/an/an/a 750n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202142
PNG
(CHEMBL396918 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2ccccc2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C22H15ClN2O3/c23-16-10-11-19(24-20(26)14-6-2-1-3-7-14)15(12-16)13-25-21(27)17-8-4-5-9-18(17)22(25)28/h1-12H,13H2,(H,24,26)
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n/an/an/an/a>1.00E+5n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202131
PNG
(CHEMBL248356 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES FC(F)(F)c1ccccc1C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C23H14ClF3N2O3/c24-14-9-10-19(28-20(30)17-7-3-4-8-18(17)23(25,26)27)13(11-14)12-29-21(31)15-5-1-2-6-16(15)22(29)32/h1-11H,12H2,(H,28,30)
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n/an/an/an/a<1.00E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50156061
PNG
(CHEMBL365797 | CHEMBL556609 | N-(4-chloro-2-((1,3-...)
Show SMILES Clc1ccc(NC(=O)c2ccccn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C21H14ClN3O3/c22-14-8-9-17(24-19(26)18-7-3-4-10-23-18)13(11-14)12-25-20(27)15-5-1-2-6-16(15)21(25)28/h1-11H,12H2,(H,24,26)
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n/an/an/an/a 250n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202118
PNG
(CHEMBL430009 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES [O-][N+](=O)c1ccccc1C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C22H14ClN3O5/c23-14-9-10-18(24-20(27)17-7-3-4-8-19(17)26(30)31)13(11-14)12-25-21(28)15-5-1-2-6-16(15)22(25)29/h1-11H,12H2,(H,24,27)
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Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50156070
PNG
(CHEMBL366217 | N-(4-Chloro-2-[(1,3-dioxo-1,3-dihyd...)
Show SMILES Oc1ccccc1C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C22H15ClN2O4/c23-14-9-10-18(24-20(27)17-7-3-4-8-19(17)26)13(11-14)12-25-21(28)15-5-1-2-6-16(15)22(25)29/h1-11,26H,12H2,(H,24,27)
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n/an/an/an/a 250n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202131
PNG
(CHEMBL248356 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES FC(F)(F)c1ccccc1C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C23H14ClF3N2O3/c24-14-9-10-19(28-20(30)17-7-3-4-8-18(17)23(25,26)27)13(11-14)12-29-21(31)15-5-1-2-6-16(15)22(29)32/h1-11H,12H2,(H,28,30)
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n/an/an/an/a 5.70E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202132
PNG
(CHEMBL395645 | N-(4-chloro-2-((4,5-dimethoxy-1,3-d...)
Show SMILES COc1ccc2C(=O)N(Cc3cc(Cl)ccc3NC(=O)c3ccccn3)C(=O)c2c1OC
Show InChI InChI=1S/C23H18ClN3O5/c1-31-18-9-7-15-19(20(18)32-2)23(30)27(22(15)29)12-13-11-14(24)6-8-16(13)26-21(28)17-5-3-4-10-25-17/h3-11H,12H2,1-2H3,(H,26,28)
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n/an/an/an/a>1.00E+5n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202136
PNG
(CHEMBL246935 | N-(4-bromo-2-((5-fluoro-1,3-dioxois...)
Show SMILES Fc1ccc2C(=O)N(Cc3cc(Br)ccc3NC(=O)c3ccccn3)C(=O)c2c1
Show InChI InChI=1S/C21H13BrFN3O3/c22-13-4-7-17(25-19(27)18-3-1-2-8-24-18)12(9-13)11-26-20(28)15-6-5-14(23)10-16(15)21(26)29/h1-10H,11H2,(H,25,27)
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n/an/an/an/a 930n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50156082
PNG
(CHEMBL362969 | N-(4-bromo-2-((1,3-dioxoisoindolin-...)
Show SMILES Brc1ccc(NC(=O)c2ccccn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C21H14BrN3O3/c22-14-8-9-17(24-19(26)18-7-3-4-10-23-18)13(11-14)12-25-20(27)15-5-1-2-6-16(15)21(25)28/h1-11H,12H2,(H,24,26)
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n/an/an/an/a<1.00E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202135
PNG
(CHEMBL245897 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)C2CCCCC2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C22H21ClN2O3/c23-16-10-11-19(24-20(26)14-6-2-1-3-7-14)15(12-16)13-25-21(27)17-8-4-5-9-18(17)22(25)28/h4-5,8-12,14H,1-3,6-7,13H2,(H,24,26)
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n/an/an/an/a<1.00E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202121
PNG
(CHEMBL397648 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Oc1cccnc1C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C21H14ClN3O4/c22-13-7-8-16(24-19(27)18-17(26)6-3-9-23-18)12(10-13)11-25-20(28)14-4-1-2-5-15(14)21(25)29/h1-10,26H,11H2,(H,24,27)
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n/an/an/an/a<1.00E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202134
PNG
(CHEMBL398125 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2ccco2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C20H13ClN2O4/c21-13-7-8-16(22-18(24)17-6-3-9-27-17)12(10-13)11-23-19(25)14-4-1-2-5-15(14)20(23)26/h1-10H,11H2,(H,22,24)
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n/an/an/an/a<1.00E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202118
PNG
(CHEMBL430009 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES [O-][N+](=O)c1ccccc1C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C22H14ClN3O5/c23-14-9-10-18(24-20(27)17-7-3-4-8-19(17)26(30)31)13(11-14)12-25-21(28)15-5-1-2-6-16(15)22(25)29/h1-11H,12H2,(H,24,27)
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n/an/an/an/a 5.70E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202127
PNG
(CHEMBL247746 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2cccnc2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C21H14ClN3O3/c22-15-7-8-18(24-19(26)13-4-3-9-23-11-13)14(10-15)12-25-20(27)16-5-1-2-6-17(16)21(25)28/h1-11H,12H2,(H,24,26)
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n/an/an/an/a 3.50E+4n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202144
PNG
(CHEMBL395644 | N-(4-chloro-2-((4-ethoxy-1,3-dioxoi...)
Show SMILES CCOc1cccc2C(=O)N(Cc3cc(Cl)ccc3NC(=O)c3ccccn3)C(=O)c12
Show InChI InChI=1S/C23H18ClN3O4/c1-2-31-19-8-5-6-16-20(19)23(30)27(22(16)29)13-14-12-15(24)9-10-17(14)26-21(28)18-7-3-4-11-25-18/h3-12H,2,13H2,1H3,(H,26,28)
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n/an/an/an/a 280n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50156070
PNG
(CHEMBL366217 | N-(4-Chloro-2-[(1,3-dioxo-1,3-dihyd...)
Show SMILES Oc1ccccc1C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C22H15ClN2O4/c23-14-9-10-18(24-20(27)17-7-3-4-8-19(17)26)13(11-14)12-25-21(28)15-5-1-2-6-16(15)22(25)29/h1-11,26H,12H2,(H,24,27)
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n/an/an/an/a<1.00E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202120
PNG
(CHEMBL247948 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2ncccn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C20H13ClN4O3/c21-13-6-7-16(24-18(26)17-22-8-3-9-23-17)12(10-13)11-25-19(27)14-4-1-2-5-15(14)20(25)28/h1-10H,11H2,(H,24,26)
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n/an/an/an/a 2.10E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202119
PNG
((E)-N-(4-chloro-2-(3-oxo-3-phenylprop-1-enyl)pheny...)
Show SMILES Clc1ccc(NC(=O)c2ccccn2)c(\C=C\C(=O)c2ccccc2)c1
Show InChI InChI=1S/C21H15ClN2O2/c22-17-10-11-18(24-21(26)19-8-4-5-13-23-19)16(14-17)9-12-20(25)15-6-2-1-3-7-15/h1-14H,(H,24,26)/b12-9+
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n/an/an/an/a 1.70E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202122
PNG
(CHEMBL246058 | N-(4-chloro-2-(3-oxo-3-phenylpropyl...)
Show SMILES Clc1ccc(NC(=O)c2ccccn2)c(CCC(=O)c2ccccc2)c1
Show InChI InChI=1S/C21H17ClN2O2/c22-17-10-11-18(24-21(26)19-8-4-5-13-23-19)16(14-17)9-12-20(25)15-6-2-1-3-7-15/h1-8,10-11,13-14H,9,12H2,(H,24,26)
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n/an/an/an/a 4.50E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202125
PNG
(CHEMBL247548 | N-(4-bromo-2-((4,5-dimethyl-1,3-dio...)
Show SMILES Cc1ccc2C(=O)N(Cc3cc(Br)ccc3NC(=O)c3ccccn3)C(=O)c2c1C
Show InChI InChI=1S/C23H18BrN3O3/c1-13-6-8-17-20(14(13)2)23(30)27(22(17)29)12-15-11-16(24)7-9-18(15)26-21(28)19-5-3-4-10-25-19/h3-11H,12H2,1-2H3,(H,26,28)
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n/an/an/an/a>1.00E+5n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202141
PNG
(CHEMBL245854 | N-(4-chloro-2-((3,5-dichloro-N-ethy...)
Show SMILES CCN(Cc1cc(Cl)ccc1NC(=O)c1ccccn1)C(=O)c1cc(Cl)cc(Cl)c1
Show InChI InChI=1S/C22H18Cl3N3O2/c1-2-28(22(30)14-9-17(24)12-18(25)10-14)13-15-11-16(23)6-7-19(15)27-21(29)20-5-3-4-8-26-20/h3-12H,2,13H2,1H3,(H,27,29)
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n/an/an/an/a 4.70E+5n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202127
PNG
(CHEMBL247746 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2cccnc2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C21H14ClN3O3/c22-15-7-8-18(24-19(26)13-4-3-9-23-11-13)14(10-15)12-25-20(27)16-5-1-2-6-17(16)21(25)28/h1-11H,12H2,(H,24,26)
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Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202124
PNG
(CHEMBL245288 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES COc1ccccc1C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C23H17ClN2O4/c1-30-20-9-5-4-8-18(20)21(27)25-19-11-10-15(24)12-14(19)13-26-22(28)16-6-2-3-7-17(16)23(26)29/h2-12H,13H2,1H3,(H,25,27)
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n/an/an/an/a<1.00E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202128
PNG
(CHEMBL247950 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2cccnn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C20H13ClN4O3/c21-13-7-8-16(23-18(26)17-6-3-9-22-24-17)12(10-13)11-25-19(27)14-4-1-2-5-15(14)20(25)28/h1-10H,11H2,(H,23,26)
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Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202143
PNG
(CHEMBL395675 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2cncs2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C19H12ClN3O3S/c20-12-5-6-15(22-17(24)16-8-21-10-27-16)11(7-12)9-23-18(25)13-3-1-2-4-14(13)19(23)26/h1-8,10H,9H2,(H,22,24)
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Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202130
PNG
(CHEMBL397393 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES COc1cccc(c1)C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C23H17ClN2O4/c1-30-17-6-4-5-14(12-17)21(27)25-20-10-9-16(24)11-15(20)13-26-22(28)18-7-2-3-8-19(18)23(26)29/h2-12H,13H2,1H3,(H,25,27)
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n/an/an/an/a<1.00E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Rattus norvegicus (Rat))		BDBM50202142
PNG
(CHEMBL396918 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2ccccc2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C22H15ClN2O3/c23-16-10-11-19(24-20(26)14-6-2-1-3-7-14)15(12-16)13-25-21(27)17-8-4-5-9-18(17)22(25)28/h1-12H,13H2,(H,24,26)
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n/an/an/an/a<1.00E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202133
PNG
(CHEMBL395389 | N-(4-bromo-2-((4-ethoxy-1,3-dioxois...)
Show SMILES CCOc1cccc2C(=O)N(Cc3cc(Br)ccc3NC(=O)c3ccccn3)C(=O)c12
Show InChI InChI=1S/C23H18BrN3O4/c1-2-31-19-8-5-6-16-20(19)23(30)27(22(16)29)13-14-12-15(24)9-10-17(14)26-21(28)18-7-3-4-11-25-18/h3-12H,2,13H2,1H3,(H,26,28)
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n/an/an/an/a 720n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50156061
PNG
(CHEMBL365797 | CHEMBL556609 | N-(4-chloro-2-((1,3-...)
Show SMILES Clc1ccc(NC(=O)c2ccccn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C21H14ClN3O3/c22-14-8-9-17(24-19(26)18-7-3-4-10-23-18)13(11-14)12-25-20(27)15-5-1-2-6-16(15)21(25)28/h1-11H,12H2,(H,24,26)
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n/an/an/an/a 250n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202137
PNG
(CHEMBL246727 | N-(2-((1,3-dioxoisoindolin-2-yl)met...)
Show SMILES Fc1cccc(NC(=O)c2ccccn2)c1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C21H14FN3O3/c22-16-8-5-10-17(24-19(26)18-9-3-4-11-23-18)15(16)12-25-20(27)13-6-1-2-7-14(13)21(25)28/h1-11H,12H2,(H,24,26)
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n/an/an/an/a>1.00E+5n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202140
PNG
(CHEMBL395388 | N-(4-chloro-2-((5-fluoro-1,3-dioxoi...)
Show SMILES Fc1ccc2C(=O)N(Cc3cc(Cl)ccc3NC(=O)c3ccccn3)C(=O)c2c1
Show InChI InChI=1S/C21H13ClFN3O3/c22-13-4-7-17(25-19(27)18-3-1-2-8-24-18)12(9-13)11-26-20(28)15-6-5-14(23)10-16(15)21(26)29/h1-10H,11H2,(H,25,27)
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n/an/an/an/a 330n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202121
PNG
(CHEMBL397648 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Oc1cccnc1C(=O)Nc1ccc(Cl)cc1CN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C21H14ClN3O4/c22-13-7-8-16(24-19(27)18-17(26)6-3-9-23-18)12(10-13)11-25-20(28)14-4-1-2-5-15(14)21(25)29/h1-10,26H,11H2,(H,24,27)
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n/an/an/an/a 260n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202117
PNG
(CHEMBL395882 | N-(4-chloro-2-((4,5-dimethyl-1,3-di...)
Show SMILES Cc1ccc2C(=O)N(Cc3cc(Cl)ccc3NC(=O)c3ccccn3)C(=O)c2c1C
Show InChI InChI=1S/C23H18ClN3O3/c1-13-6-8-17-20(14(13)2)23(30)27(22(17)29)12-15-11-16(24)7-9-18(15)26-21(28)19-5-3-4-10-25-19/h3-11H,12H2,1-2H3,(H,26,28)
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n/an/an/an/a 2.20E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202135
PNG
(CHEMBL245897 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)C2CCCCC2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C22H21ClN2O3/c23-16-10-11-19(24-20(26)14-6-2-1-3-7-14)15(12-16)13-25-21(27)17-8-4-5-9-18(17)22(25)28/h4-5,8-12,14H,1-3,6-7,13H2,(H,24,26)
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n/an/an/an/a 1.50E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))		BDBM50202129
PNG
(CHEMBL247349 | N-(4-bromo-2-((4,5-dimethoxy-1,3-di...)
Show SMILES COc1ccc2C(=O)N(Cc3cc(Br)ccc3NC(=O)c3ccccn3)C(=O)c2c1OC
Show InChI InChI=1S/C23H18BrN3O5/c1-31-18-9-7-15-19(20(18)32-2)23(30)27(22(15)29)12-13-11-14(24)6-8-16(13)26-21(28)17-5-3-4-10-25-17/h3-11H,12H2,1-2H3,(H,26,28)
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n/an/an/an/a>1.00E+5n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay

Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%